CHEMBL2208354


SMILES COc1ccc2cc(CCNC(=O)c3ccc4c(c3)C3(C)CCN(CC5CC5)C(C4)C3C)ccc2c1
InChIKey YIYFILGSLZRBRB-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 3
Hydrogen bond donors 1
Rotatable bonds 7
Molecular weight (Da) 482.3

Drug properties

Molecular type Small molecule
Endogenous/Surrogate Surrogate
Approved drug No

Database connections

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
δ OPRD Human Opioid A pKi 8.66 8.66 8.66 ChEMBL
κ OPRK Human Opioid A pKi 9.35 9.35 9.35 ChEMBL
μ OPRM Human Opioid A pKi 10.19 10.19 10.19 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
δ OPRD Human Opioid A pEC50 8.12 8.12 8.12 ChEMBL
κ OPRK Human Opioid A pEC50 8.89 8.89 8.89 ChEMBL
μ OPRM Human Opioid A pIC50 7.35 7.35 7.35 ChEMBL